BAS 13252036
TL;DR: BAS 13252036 (CAS 875006-52-3) is a chemical compound with molecular formula C23H23N5O2S and molecular weight 433.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one
Also Known As: BAS 13252036, 3-((4-methyl-5-(morpholinomethyl)-4H-1,2,4-triazol-3-yl)thio)-4-phenylquinolin-2(1H)-one, 3-{[4-methyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one, 3-[[4-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one, 3-{[4-methyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2-ol
| Molecular Formula | C23H23N5O2S |
|---|---|
| Molecular Weight | 433.16 g/mol |
| LogP | 3.307 |
| Topological Polar Surface Area | 76.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 433.15726 |
| Heavy Atoms | 31 |
| Complexity | 1262.1935 |
Chemical Identifiers
| CAS Number | 875006-52-3 |
|---|---|
| SMILES | CN1C(=NN=C1SC2=C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4)CN5CCOCC5 |
Product Overview
BAS 13252036 (CAS 875006-52-3), with molecular formula C23H23N5O2S and molecular weight 433.16 g/mol. IUPAC: 3-[[4-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one.
Chemical Property Profile of BAS 13252036
Property Insights of BAS 13252036
The XLogP value of 3.307 indicates that BAS 13252036 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.04 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13252036. Following Lipinski's Rule of Five, BAS 13252036 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 13252036?
The CAS number of BAS 13252036 is 875006-52-3.
What is the molecular formula of BAS 13252036?
The molecular formula of BAS 13252036 is C23H23N5O2S.
What is the molecular weight of BAS 13252036?
The molecular weight of BAS 13252036 is 433.16 g/mol.
Where can I buy BAS 13252036?
You can request a quote for BAS 13252036 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13252036?
Yes, KEHONG BIO provides custom synthesis services for BAS 13252036 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.